1-(3,5-dimethylphenyl)-2-[ethyl(2-methoxyethyl)amino]ethanol

C15H25NO2 — CID 79038389

IUPAC1-(3,5-dimethylphenyl)-2-[ethyl(2-methoxyethyl)amino]ethanol
SMILESCCN(CCOC)CC(O)c1cc(C)cc(C)c1
InChIInChI=1S/C15H25NO2/c1-5-16(6-7-18-4)11-15(17)14-9-12(2)8-13(3)10-14/h8-10,15,17H,5-7,11H2,1-4H3
InChIKeyGXJPUDROBOLKEX-UHFFFAOYSA-N
MW251.37 g/mol
LogP2.31
Rot. Bonds7

About 1-(3,5-dimethylphenyl)-2-[ethyl(2-methoxyethyl)amino]ethanol

1-(3,5-dimethylphenyl)-2-[ethyl(2-methoxyethyl)amino]ethanol (PubChem CID 79038389) has the molecular formula C15H25NO2 and a molecular weight of 251.37 g/mol. Its IUPAC name is 1-(3,5-dimethylphenyl)-2-[ethyl(2-methoxyethyl)amino]ethanol.

Molecular Properties

Compound Name1-(3,5-dimethylphenyl)-2-[ethyl(2-methoxyethyl)amino]ethanol
PubChem CID79038389
Molecular FormulaC15H25NO2
Molecular Weight251.37 g/mol
Exact Mass251.19
IUPAC Name1-(3,5-dimethylphenyl)-2-[ethyl(2-methoxyethyl)amino]ethanol
SMILESCCN(CCOC)CC(O)c1cc(C)cc(C)c1
InChIInChI=1S/C15H25NO2/c1-5-16(6-7-18-4)11-15(17)14-9-12(2)8-13(3)10-14/h8-10,15,17H,5-7,11H2,1-4H3
InChIKeyGXJPUDROBOLKEX-UHFFFAOYSA-N
XLogP2.31
TPSA32.70 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500251.37
LogP ≤ 52.31
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-(3,5-dimethylphenyl)-2-[2-methoxyethyl(2-methylpropyl)amino]ethanol
CID 79038886
1-(3,5-dimethylphenyl)-2-[2-methoxyethyl(1-methoxypropan-2-yl)amino]ethanol
CID 79037152
2-[butan-2-yl(2-methoxyethyl)amino]-1-(3,5-dimethylphenyl)ethanol
CID 79040475
2-[ethyl(2-methoxyethyl)amino]-1-(2-methoxy-5-methylphenyl)ethanol
CID 54983134
2-[1-cyclopropylethyl(2-methoxyethyl)amino]-1-(3,5-dimethylphenyl)ethanol
CID 79037102
(2R)-1-[ethyl(2-methoxyethyl)amino]propan-2-ol
CID 103935037
N'-ethyl-N'-(2-methoxyethyl)-1-(4-methylphenyl)ethane-1,2-diamine
CID 61448002
1-(3-amino-4-methylphenyl)-2-[bis(2-methoxyethyl)amino]ethanol
CID 82071614
2-[bis(2-methoxyethyl)amino]-1-(4-methoxyphenyl)ethanol
CID 60980971
1-(4-aminophenyl)-2-[2-methoxyethyl(2-methylpropyl)amino]ethanol
CID 62265758
1-amino-3-[ethyl(2-methoxyethyl)amino]propan-2-ol
CID 61447893
3-[[2-(3-aminophenyl)-2-hydroxyethyl]-(2-methoxyethyl)amino]propanenitrile
CID 63284375

Frequently Asked Questions

What is the IUPAC name of 1-(3,5-dimethylphenyl)-2-[ethyl(2-methoxyethyl)amino]ethanol?
The IUPAC name of 1-(3,5-dimethylphenyl)-2-[ethyl(2-methoxyethyl)amino]ethanol (CID 79038389) is 1-(3,5-dimethylphenyl)-2-[ethyl(2-methoxyethyl)amino]ethanol.
What is the SMILES notation for 1-(3,5-dimethylphenyl)-2-[ethyl(2-methoxyethyl)amino]ethanol?
The canonical SMILES for 1-(3,5-dimethylphenyl)-2-[ethyl(2-methoxyethyl)amino]ethanol is CCN(CCOC)CC(O)c1cc(C)cc(C)c1.
What is the InChIKey of 1-(3,5-dimethylphenyl)-2-[ethyl(2-methoxyethyl)amino]ethanol?
The InChIKey is GXJPUDROBOLKEX-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H25NO2/c1-5-16(6-7-18-4)11-15(17)14-9-12(2)8-13(3)10-14/h8-10,15,17H,5-7,11H2,1-4H3.
What are the key properties of 1-(3,5-dimethylphenyl)-2-[ethyl(2-methoxyethyl)amino]ethanol?
1-(3,5-dimethylphenyl)-2-[ethyl(2-methoxyethyl)amino]ethanol has a molecular weight of 251.37 g/mol, XLogP of 2.31, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3,5-dimethylphenyl)-2-[ethyl(2-methoxyethyl)amino]ethanol is sourced from PubChem (CID 79038389), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).